3-(4-Isopropylphenyl)propan-1-amine - CAS 165736-01-6

Name: 3-(4-Isopropylphenyl)propan-1-amine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012211
Product Name:	3-(4-Isopropylphenyl)propan-1-amine
CAS:	165736-01-6
Synonyms:	3-(4-propan-2-ylphenyl)propan-1-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(4-propan-2-ylphenyl)propan-1-amine
Description:	3-(4-Isopropylphenyl)propan-1-amine (CAS# 165736-01-6) is a useful research chemical.
Molecular Weight:	177.29
Molecular Formula:	C12H19N
Canonical SMILES:	CC(C)C1=CC=C(C=C1)CCCN
InChI:	InChI=1S/C12H19N/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h5-8,10H,3-4,9,13H2,1-2H3
InChI Key:	RNWADJRXWKNYLC-UHFFFAOYSA-N
Boiling Point:	266.964 °C at 760 mmHg
Density:	0.921 g/cm³
MDL:	MFCD07374082
LogP:	3.40160

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Related Functional Groups

Nitrogen Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[937273-31-9]C12H14ClNO4
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile
[916792-07-9]C8H5BrFN
2-Bromo-4-fluoro-5-methylbenzonitrile
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2021024489-A1	Treatment and prevention of neuropathic pain with p2y14 antagonists	20190723
US-2021047293-A1	Heterocyclic p2y14 receptor antagonists	20180209
CA-2852863-A1	Scale-up process of bifunctionalized triblock copolymers with secondary and tertiary amines, with application in dewatering and desalting of heavy crude oils	20130605
CA-2852863-C	Scale-up process of bifunctionalized triblock copolymers with secondary and tertiary amines, with application in dewatering and desalting of heavy crude oils	20130605
US-10125226-B2	Scale-up process of bifunctionalized triblock copolymers with secondary and tertiary amines, with application in dewatering and desalting of heavy crude oils	20130605

Complexity:	123
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.151749610
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	177.151749610
Rotatable Bond Count:	4
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7